Riboflavin 5'-sulfate
TL;DR: Riboflavin 5'-sulfate (CAS 1107-62-6) is a chemical compound with molecular formula C17H20N4O9S and molecular weight 456.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R,4R)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen sulfate
Also Known As: Riboflavin 5'-sulfate, [(2S,3R,4R)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen sulfate, [(2S,3R,4R)-5-{7,8-dimethyl-2,4-dioxo-3H-benzo[g]pteridin-10-yl}-2,3,4-trihydroxypentyl]oxysulfonic acid, 5-Deoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-1-O-sulfo-D-ribitol
| Molecular Formula | C17H20N4O9S |
|---|---|
| Molecular Weight | 456.10 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 207.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 456.0951 |
| Heavy Atoms | 31 |
| Complexity | 900.0 |
Chemical Identifiers
| CAS Number | 1107-62-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@H]([C@H]([C@H](COS(=O)(=O)O)O)O)O |
| InChIKey | RUUGCTAFWMEMDH-MBNYWOFBSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Riboflavin 5'-sulfate (CAS 1107-62-6), with molecular formula C17H20N4O9S and molecular weight 456.10 g/mol. IUPAC: [(2S,3R,4R)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen sulfate.
Chemical Property Profile of Riboflavin 5'-sulfate
Property Insights of Riboflavin 5'-sulfate
The XLogP value of -1.8 indicates that Riboflavin 5'-sulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 207.0 Ų indicates high polarity, suggesting Riboflavin 5'-sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Riboflavin 5'-sulfate has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Riboflavin 5'-sulfate?
The CAS number of Riboflavin 5'-sulfate is 1107-62-6.
What is the molecular formula of Riboflavin 5'-sulfate?
The molecular formula of Riboflavin 5'-sulfate is C17H20N4O9S.
What is the molecular weight of Riboflavin 5'-sulfate?
The molecular weight of Riboflavin 5'-sulfate is 456.10 g/mol.
Where can I buy Riboflavin 5'-sulfate?
You can request a quote for Riboflavin 5'-sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Riboflavin 5'-sulfate?
Yes, KEHONG BIO provides custom synthesis services for Riboflavin 5'-sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.